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1993054-67-3 | 5-Pyrrolidin-2-ylisoxazole dihydrochloride
CAS No: 1993054-67-3 Catalog No: AG00I3P0 MDL No:
Product Description
Catalog Number:
AG00I3P0
Chemical Name:
5-Pyrrolidin-2-ylisoxazole dihydrochloride
CAS Number:
1993054-67-3
IUPAC Name:
5-pyrrolidin-2-yl-1,2-oxazole;dihydrochloride
InChI:
InChI=1S/C7H10N2O.2ClH/c1-2-6(8-4-1)7-3-5-9-10-7;;/h3,5-6,8H,1-2,4H2;2*1H
InChI Key:
CXCIBLKWPVWIFA-UHFFFAOYSA-N
Properties
Complexity:
118
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
210.033g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
211.086g/mol
Monoisotopic Mass:
210.033g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
38.1A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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